CHEBI:223526 - Tomophagusin G

ChEBI IDCHEBI:223526
ChEBI NameTomophagusin G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC32H44O6
Net Charge0
Average Mass524.698
Monoisotopic Mass524.31379
SMILESCC(=O)O[C@@H]1C[C@H]([C@H](C)[C@@H]2CC=C(C)C(=O)O2)[C@@]2(C)CCC3=C(CC[C@@H]4C(=CCC(=O)OC4(C)C)C3)[C@]12C
InChIInChI=1S/C32H44O6/c1-18-8-12-26(37-29(18)35)19(2)25-17-27(36-20(3)33)32(7)24-11-10-23-21(9-13-28(34)38-30(23,4)5)16-22(24)14-15-31(25,32)6/h8-9,19,23,25-27H,10-17H2,1-7H3/t19-,23+,25+,26-,27+,31+,32+/m0/s1
InChIKeyGUCLGNSFMGJGGD-LPVBNXFNSA-N
Species of MetaboliteComponentSourceComments
Tomophagusspecies (ncbitaxon:2782489) - PubMed (30983350)
ChEBI Ontology
Outgoing Relation(s)
Tomophagusin G (CHEBI:223526) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
[(9R,13R,14R,16R,17R)-8,8,13,17-tetramethyl-16-[(1S)-1-[(2S)-5-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-6-oxo-7-oxatetracyclo[10.7.0.03,9.013,17]nonadeca-1(12),3-dien-14-yl] acetate